7-Azaindole-3-carboxaldehyde - CAS 4649-09-6
Catalog: |
BB026139 |
Product Name: |
7-Azaindole-3-carboxaldehyde |
CAS: |
4649-09-6 |
Synonyms: |
1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde |
IUPAC Name: | 1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde |
Description: | A reagent used in the preparation of biologically active Azaindoles. |
Molecular Weight: | 146.15 |
Molecular Formula: | C8H6N2O |
Canonical SMILES: | C1=CC2=C(NC=C2C=O)N=C1 |
InChI: | InChI=1S/C8H6N2O/c11-5-6-4-10-8-7(6)2-1-3-9-8/h1-5H,(H,9,10) |
InChI Key: | KAIWRKYDYWYFIT-UHFFFAOYSA-N |
Boiling Point: | 361.1 °C at 760 mmHg |
Purity: | 97.0 % |
Density: | 1.368 g/cm3 |
MDL: | MFCD03407363 |
LogP: | 1.37540 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P272, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P333+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112409353-A | Preparation method of 7-azaindole derivative | 20201127 |
CN-112552305-A | Novel benzocyclohepta-imidazopyridine flame-retardant ultraviolet-resistant molecular material and preparation method and application thereof | 20201126 |
WO-2021041539-A2 | Compounds and methods of use | 20190828 |
CN-110526854-A | A kind of É', alpha, beta-unsaturated ketone derivative, preparation method and the purposes as drug | 20190726 |
WO-2021017795-A1 | α,β-UNSATURATED KETONE DERIVATIVE, PREPARATION METHOD AND USE AS MEDICINE | 20190726 |
Complexity: | 160 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 146.048012819 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 146.048012819 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 45.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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